File name: Pandora132s1_Berlin_20240820_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T225126.4Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20240820_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20240820 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20240820T050420.2Z 8998.211344 186 1 50.52 2 81.17 81.32 96.12 255.66 0.00 1 0.00 1 0 17 4.931e-01 3.263e-02 3.441e-01 2.071e-02 7.818810e-01 1.238638e-02 9.505182e-03 -6.000000e+00 2.985920e-01 231.83 -2.00 3.85 -2.00 321.84 0.00e+00 7.204413e-03 6.260346e-03 9.250287e-04 -6.000000e+00 1.506269e-02 282.24 -2.00 20.00 -2.00 321.32 0.00e+00 6.157 0.005 302.00 328.00 3 2.8664e+00 4.4644e-02 7.7656e-02 -6.0000e+00 7.5599e-01 8.9534e-01 5.8114e-02 5.0780e-02 -6.0000e+00 8.2654e-01 -1.1647e+00 4.8960e-02 2.4390e-02 -6.0000e+00 4.8161e-01 4.7667e-01 2.3244e-02 1.1256e-02 -6.0000e+00 2.0150e-01 2.7509e-05 -1.0595e-03 6.2298e-04 1.3542e-04 -6.0000e+00 1.4504e-02 7.9201e-02 0.0000e+00 12 8 8 10 0 0 -25.80 15.68 0.84 0.07920 0.07124 22 5 4 8 0 2295.690 15.00 15.68 23.02 30.87 31.30 31.0 991.17 900000 -19837 900000 -90245 900000 93031 900000 1227 900000 -49584 -147229 900000 -72059 900000 -67351 72626 900000 -21115 900000 900000 900000 -47320 900000 46078 -53426 900000 -21101 900000 -67129 115402 10374 900000 -49520 900000 -16674 96542 35794 76969 241612 -5722 145856 23118 189336 25091 74701 54006 62986 -897 40202 113533 7597 127129 25263 73064 31590 52667 26840 10645 24121 16078 27236 -8795 98611 3441 9635 12312 48037 -2726 16539 19712 -882 14829 -7643 31803 7126 13384 -7126 12226 674 -1539 14439 -6444 3804 1266 6650 -6070 1190 -5757 1044 4714 -7773 -669 -7365 4601 -2449 -2599 -3988 -3030 -3287 1291 -3066 -7184 7143 -1286 -2036 -901 -2441 -5085 -3026 1674 -271 1971 -868 -906 -1605 1623 -2953 -2655 2232 2480 2293 1002 3077 699 4571 -1060 3789 1549 -1035 2699 -598 2028 -1172 1558 128 594 -620 -183 -397 -307 -893 -2325 900000 900000 -466 900000 -3329 900000 1872 900000 25 900000 -1179 -9135 900000 -3559 900000 -4559 1461 900000 -1082 900000 900000 900000 -2770 900000 1096 -3421 900000 -888 900000 -4544 2322 455 900000 -4711 900000 -1007 1943 1506 2535 4862 -544 3202 1776 3810 1882 3416 3063 3342 -94 2942 4798 931 5628 3004 5614 3756 5106 3290 1461 2780 2030 3338 -1754 8334 730 1904 2320 6503 -673 3843 4868 -278 3907 -2349 5934 1512 2473 -1642 2617 194 -535 4913 -2982 1691 611 3224 -3509 658 -3391 554 2259 -3953 -306 -3746 2349 -1577 -1969 -3538 -2944 -3265 1155 -2564 -5664 4822 -1005 -1706 -790 -2336 -5544 -3682 2187 -389 2826 -1254 -1253 -2159 2126 -4241 -4027 3344 3666 3250 1377 4014 903 5478 -1305 4651 2210 -1742 4874 -1200 4203 -2680 3708 325 1537 -1638 -478 -999 -721 -1952 -4938 900000 SS 20240820T052004.8Z 8998.222278 192 1 49.84 2 78.79 84.39 98.32 258.66 0.00 1 0.00 1 0 25 4.758e-01 1.214e-02 2.529e-01 7.010e-03 6.773041e-01 3.944647e-03 8.324079e-03 -6.000000e+00 2.786322e-01 231.83 -2.00 3.85 -2.00 321.46 0.00e+00 2.891809e-03 1.942144e-03 2.160845e-03 -6.000000e+00 1.284904e-02 282.24 -2.00 20.00 -2.00 320.91 0.00e+00 4.965 0.003 302.00 328.00 3 2.5693e+00 1.3811e-02 6.5325e-02 -6.0000e+00 7.0120e-01 1.8283e-01 1.8975e-02 4.5523e-02 -6.0000e+00 7.6011e-01 -2.0738e-01 1.8848e-02 2.1246e-02 -6.0000e+00 4.4849e-01 7.9531e-02 8.8837e-03 7.3845e-03 -6.0000e+00 1.8968e-01 1.4299e-04 -1.6453e-03 2.0777e-04 8.0218e-05 -6.0000e+00 1.3255e-02 7.8859e-02 0.0000e+00 12 8 8 10 0 0 16.72 15.77 0.43 0.07886 0.06650 62 13 4 8 0 803.660 15.00 15.77 23.64 30.87 31.30 30.8 993.08 -124492 -115750 -157185 -213038 -227059 -174179 -161050 900000 -88971 900000 -137684 -135147 -112460 -45998 48066 -48266 -21713 -12998 98499 -30452 15392 -58387 -37275 -13491 -35515 -47383 -20121 -12553 -15516 47250 32587 20443 6990 -2591 -8485 -27259 -25203 5472 21355 31816 8801 -5361 8422 5106 12873 5794 13841 9522 6730 13143 9252 19325 6137 13381 13730 789 1655 8388 7767 -2431 4592 1189 4127 6688 939 5798 3629 4289 -1556 2352 -1126 -3901 267 -349 1053 -3987 -4449 -1970 2760 -5545 -843 -3685 -3848 -1140 -1613 1160 -248 832 2286 998 -239 -1409 -1185 1092 710 -991 199 -175 1029 -1043 972 -1175 -559 27 -1532 -400 -1250 331 -426 1269 -659 854 -606 123 667 201 355 -824 -200 -235 443 83 937 -405 -21 1262 681 1003 -166 402 -1173 331 158 280 -82 -226 507 -27 -424 -452 653 -609 900000 -928 -863 -1757 -3837 -4513 -2164 -2001 900000 -729 900000 -2164 -2350 -2228 -597 328 -890 -341 -204 673 -624 200 -1636 -917 -286 -995 -1522 -481 -274 -371 710 690 573 244 -97 -330 -1378 -1481 292 1167 1783 673 -498 702 447 1064 527 1201 904 704 1428 1176 2456 880 1903 2038 138 287 1456 1327 -427 821 250 954 1612 238 1369 897 1159 -513 830 -433 -1536 96 -115 308 -1134 -1274 -609 963 -2480 -413 -2051 -2290 -703 -1066 787 -177 585 1534 637 -144 -820 -703 703 532 -877 199 -193 1144 -1118 918 -1033 -485 25 -1520 -414 -1391 396 -577 1875 -1059 1368 -956 183 941 285 523 -1301 -328 -384 694 124 1352 -571 -29 1622 907 1489 -282 751 -2374 694 353 668 -207 -587 1323 -71 -1081 -1083 1449 -1319 900000 SS 20240820T052720.7Z 8998.227323 195 1 49.36 2 77.69 85.81 99.34 260.04 0.00 1 0.00 1 0 25 3.606e-01 1.018e-02 1.947e-01 4.366e-03 6.227647e-01 2.401082e-03 7.708484e-03 -6.000000e+00 2.119721e-01 231.83 -2.00 3.85 -2.00 321.15 0.00e+00 3.706932e-03 1.103033e-03 8.305918e-04 -6.000000e+00 9.303022e-03 282.24 -2.00 20.00 -2.00 320.58 0.00e+00 4.554 0.002 302.00 328.00 3 2.2947e+00 8.0119e-03 5.8836e-02 -6.0000e+00 5.3174e-01 9.9890e-02 1.0756e-02 3.8735e-02 -6.0000e+00 5.7615e-01 -9.6864e-02 1.0515e-02 1.9162e-02 -6.0000e+00 3.4053e-01 3.1409e-02 5.0385e-03 7.1345e-03 -6.0000e+00 1.4442e-01 2.9628e-04 -1.4063e-03 1.2852e-04 7.6973e-05 -6.0000e+00 1.0056e-02 7.9457e-02 0.0000e+00 12 8 8 10 0 0 -1.86 15.78 0.26 0.07946 0.06889 102 22 4 8 0 483.770 14.92 15.78 23.86 30.99 31.41 30.8 994.21 900000 -114166 -71980 -16839 -173799 900000 -190529 -401 -146303 -93297 -130469 -12011 -84935 -58666 85667 -66875 32069 -55243 43364 -48238 -14071 11426 -5099 -11168 -29269 28347 -38086 12279 -54208 10278 -32562 4042 -9088 -3026 -6955 -11500 12453 -16278 15609 -5259 2396 1872 2643 5292 2554 16289 927 16488 -4192 7787 7107 7582 523 5711 5658 1801 4556 278 5209 -229 5684 1940 4337 4354 840 4194 -1256 4617 -256 2535 -268 1901 759 -440 1022 -1280 201 -717 1569 -2988 -2234 -2372 -2197 -933 -659 -501 -347 1432 -170 2001 -371 571 -55 41 -355 -558 1208 -1111 341 -574 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